Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR4 | Q13639 | 10/20 | 0.65 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | ACHE | P22303 | 1/20 | 0.42 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.35 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.35 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL5112472 | 0.93 | HTR4 (0.63) | HTR4CYP3A4ACHE | |
| SCHEMBL5112620 | 0.92 | HTR4 (0.61) | HTR4CYP3A4ACHE | |
| SCHEMBL5121617 | 0.91 | HTR4 (0.63) | HTR4CYP3A4ACHE | |
| SCHEMBL5127825 | 0.89 | HTR4 (0.63) | HTR4CYP3A4ACHE | |
| SCHEMBL5341243 | 0.88 | HTR4 (0.60) | HTR4CYP3A4ACHE | |
| SCHEMBL5120793 | 0.85 | HTR4 (0.64) | HTR4CYP3A4ACHE | |
| SCHEMBL5115692 | 0.85 | HTR4 (0.63) | HTR4CYP3A4ACHE | |
| SCHEMBL5124117 | 0.85 | HTR4 (0.66) | HTR4CYP3A4ACHE | |
| SCHEMBL5112331 | 0.84 | HTR4 (0.72) | HTR4CYP3A4ACHE | |
| SCHEMBL5120856 | 0.84 | HTR4 (0.60) | HTR4CYP3A4ACHE |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1856114-B1 | BENZISOXAZOLE DERIVATIVES | PFIZER (US) | 2014-08-20 | — | — | EP | disclosed |